4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-5.163928196349352 pbc="F T F" Ni 0.23171545 0.18190327 -0.17816502 28 -5.62273567 -4.13705169 -7.12909970 Ni 1.71219253 1.42485375 0.12990665 28 7.09139309 3.59185199 -4.45123486 Ni 1.28220450 0.28278197 1.56210000 28 6.31431572 -3.89949566 6.34739846 Ni 0.13362859 1.32702941 1.57034430 28 -7.78297313 4.44469536 5.23293609